F538-0808 Screening compound: 3-[3-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)phenyl]-1-phenylurea

F538-0808 Screening compound: 3-[3-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)phenyl]-1-phenylurea
F538-0808 Screening compound: 3-[3-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)phenyl]-1-phenylurea alternative view

Chemical Structure Depiction of ChemDiv screening compound F538-0808
3-[3-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)phenyl]-1-phenylurea

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

F538-0808

Molecular Formula

C21H22N4O2 (C21 H22 N4 O2)

Compound Name

3-[3-(5-cyclohexyl-1,2,4-oxadiazol-3-yl)phenyl]-1-phenylurea

IUPAC name

3-[3-(5-cyclohexyl-124-oxadiazol-3-yl)phenyl]-1-phenylurea

SMILES

O=C(Nc1ccccc1)Nc1cc(-c2noc(C3CCCCC3)n2)ccc1

InChI

InChI=1S/C21H22N4O2/c26-21(22-17-11-5-2-6-12-17)23-18-13-7-10-16(14-18)19-24-20(27-25-19)15-8-3-1-4-9-15/h2,5-7,10-15H,1,3-4,8-9H2,(H2,22,23,26)

InChI Key

JXVHWOFPABLRFI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27173940

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

362.43

Hydrogen Bond Acceptors Count

5.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

6

Partition Coefficient, logP

6.418

Distribution Coefficient, logD

6.418

Water Solubility, LogSw

-5.99

Polar Surface Area

64.139

Acid Dissociation Constant (pKa)

13.71

Base Dissociation Constant (pKb)

0.26

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

28.60

F538-0808 in Drug Discovery

Included in Screening Libraries

3D-Diversity Natural-Product-Like Library (18102 compounds)

Targeted Diversity Library (40567 compounds)

Included in 1.7M Stock Database

Structure:
  • 3D

References: we are preparing a list of scientific research reports with F538-0808 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound F538-0808?
Check Price and Availability of F538-0808, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of F538-0808 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for F538-0808
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for F538-0808
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of F538-0808 available by request